2-pentan-3-yloxypyridin-3-amine

C10H16N2O — CID 45091266

IUPAC2-pentan-3-yloxypyridin-3-amine
SMILESCCC(CC)Oc1ncccc1N
InChIInChI=1S/C10H16N2O/c1-3-8(4-2)13-10-9(11)6-5-7-12-10/h5-8H,3-4,11H2,1-2H3
InChIKeyKROFAPYARXNMCX-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.23
Rot. Bonds4

About 2-pentan-3-yloxypyridin-3-amine

2-pentan-3-yloxypyridin-3-amine (PubChem CID 45091266) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-pentan-3-yloxypyridin-3-amine.

Molecular Properties

Compound Name2-pentan-3-yloxypyridin-3-amine
PubChem CID45091266
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-pentan-3-yloxypyridin-3-amine
SMILESCCC(CC)Oc1ncccc1N
InChIInChI=1S/C10H16N2O/c1-3-8(4-2)13-10-9(11)6-5-7-12-10/h5-8H,3-4,11H2,1-2H3
InChIKeyKROFAPYARXNMCX-UHFFFAOYSA-N
XLogP2.23
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-pentan-3-yloxypyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-pentan-3-yloxypyridin-3-amine?
The IUPAC name of 2-pentan-3-yloxypyridin-3-amine (CID 45091266) is 2-pentan-3-yloxypyridin-3-amine.
What is the SMILES notation for 2-pentan-3-yloxypyridin-3-amine?
The canonical SMILES for 2-pentan-3-yloxypyridin-3-amine is CCC(CC)Oc1ncccc1N.
What is the InChIKey of 2-pentan-3-yloxypyridin-3-amine?
The InChIKey is KROFAPYARXNMCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-3-8(4-2)13-10-9(11)6-5-7-12-10/h5-8H,3-4,11H2,1-2H3.
What are the key properties of 2-pentan-3-yloxypyridin-3-amine?
2-pentan-3-yloxypyridin-3-amine has a molecular weight of 180.25 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pentan-3-yloxypyridin-3-amine is sourced from PubChem (CID 45091266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).